Vitas-M small molecule compound

(7-methoxy-1H-indol-3-yl)[4-(phenylsulfonyl)piperazin-1-yl]acetic acid

Catalog ID
STL236097
SMILES COc1cccc2c1[nH]cc2C(N1CCN(CC1)S(=O)(=O)c1ccccc1)C(=O)O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C21H23N3O5S MW 429.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O5S/c1-29-18-9-5-8-16-17(14-22-19(16)18)20(21(25)26)23-10-12-24(13-11-23)30(27,28)15-6-3-2-4-7-15/h2-9,14,20,22H,10-13H2,1H3,(H,25,26)
InChIKey
RFLQPQUWBZPOFS-UHFFFAOYSA-N
Synonyms
1081120-41-3
(7methoxy1Hindol3yl)(4(phenylsulfonyl)piperazin1yl)aceticacid
1081120413
2(4(benzenesulfonyl)piperazin1yl)2(7methoxy1Hindol3yl)aceticacid
2(7methoxy1Hindol3yl)2(4(phenylsulfonyl)piperazin1yl)aceticacid
COC1=CC=CC2=C1NC=C2C(C(=O)O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4
COc1cccc2c1(nH)cc2C(N1CCN(CC1)S(=O)(=O)c1ccccc1)C(=O)O
InChI=1SC21H23N3O5Sc129189581617(142219(16)18)20(21(25)26)23101224(131123)30(2728)156324715h29142022H1013H21H3(H2526)
MFCD12208299
ZINC000020732587
ZINC000020732591

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Available files

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